Glycoside
GD081852
Name:
NoneFormula:
C20H27O7N3Smiles:
O=C(C(=O)N1CCC[C@]2(CCC(=O)N2Cc2ccncc2)C1)[C@H](O)[C@@H](O)[C@H](O)COAglycone:
O=C1CCC2(CCCNC2)N1Cc1ccncc1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.6 |
| AlogP: | -1.79 | Num_rotatable_bonds: | 7 |
| MolWt: | 421.45 | Num_heavy_atoms: | 30 |
| TPSA: | 151.5 | NumAromaticRings: | 1 |
Unique Aglycone
AD36779
Formula: C14H19ON3
Smiles:
O=C1CCC2(CCCNC2)N1Cc1ccncc1| HBA: | 4 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.57 |
| AlogP: | 1.33 | Num_rotatable_bonds: | 2 |
| MolWt: | 245.33 | Num_heavy_atoms: | 18 |
| TPSA: | 45.23 | NumAromaticRings: | 1 |
